#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a5m s LYS 2 N 0.00 2.33 0.00 1.43 1.02 -1.26 -4.90 119.74 118.37 2a5m s LYS 2 Ca 0.00 0.93 0.00 0.00 0.02 0.00 0.00 55.97 56.92 2a5m s LYS 2 Cb 0.00 -4.52 0.00 0.00 -0.52 0.00 0.00 37.83 32.79 2a5m s LYS 2 CO 0.00 -3.09 0.00 0.25 -0.92 0.00 0.00 175.35 171.59 2a5m n THR 3 N 7.66 0.00 0.00 2.17 -2.24 -1.26 -5.13 114.28 115.48 2a5m n THR 3 Ca 0.30 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 2a5m n THR 3 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2a5m n THR 3 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a5m n GLY 4 N 5.00 -1.44 3.81 3.38 0.00 -1.26 -5.16 105.19 109.52 2a5m n GLY 4 Ca 0.00 0.91 -0.33 0.00 0.00 0.00 0.00 46.02 46.59 2a5m n GLY 4 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a5m s GLY 5 N 0.00 2.43 -0.14 -0.02 0.00 -1.26 -4.71 107.32 103.61 2a5m s GLY 5 Ca 0.00 0.45 -0.11 0.00 0.00 0.00 0.00 44.72 45.06 2a5m s GLY 5 CO 0.00 0.75 0.36 1.25 0.00 0.00 0.00 173.10 175.46 2a5m s LYS 6 N -3.16 0.39 -0.01 2.90 2.20 -0.77 -4.61 119.74 116.69 2a5m s LYS 6 Ca 0.63 0.58 0.04 0.00 -0.36 0.00 0.00 55.97 56.86 2a5m s LYS 6 Cb -0.11 0.11 -0.01 0.00 -1.51 0.00 0.00 37.83 36.31 2a5m s LYS 6 CO 0.15 -0.09 -0.13 -1.50 -0.36 0.00 0.00 175.35 173.42 2a5m s ILE 7 N 0.62 1.00 -0.09 5.43 2.07 -0.84 -1.23 121.20 128.17 2a5m s ILE 7 Ca -0.04 -0.53 0.04 0.00 -1.41 0.00 0.00 60.65 58.71 2a5m s ILE 7 Cb -0.05 -0.84 0.00 0.00 0.13 0.00 0.00 42.46 41.70 2a5m s ILE 7 CO -0.04 0.29 -0.21 -0.55 -1.91 0.00 0.00 174.94 172.51 2a5m s SER 8 N -0.24 2.76 -0.07 4.50 0.15 0.65 -1.44 113.70 120.01 2a5m s SER 8 Ca 0.04 -0.49 0.01 0.00 0.70 0.00 0.00 55.95 56.20 2a5m s SER 8 Cb -0.05 -1.22 -0.03 0.00 -1.71 0.00 0.00 66.02 63.00 2a5m s SER 8 CO -0.00 0.14 -0.06 -0.36 1.20 0.00 0.00 173.24 174.15 2a5m s PHE 9 N 0.38 2.96 -0.02 3.44 0.40 -0.20 -0.22 117.98 124.71 2a5m s PHE 9 Ca -0.17 0.04 0.07 0.00 -0.60 0.00 0.00 56.93 56.27 2a5m s PHE 9 Cb -0.17 -1.72 -0.02 0.00 0.51 0.00 0.00 43.02 41.63 2a5m s PHE 9 CO 0.07 0.35 -0.23 0.71 0.70 0.00 0.00 175.22 176.82 2a5m s TYR 10 N -0.82 2.06 0.32 0.36 1.51 -0.57 -1.09 117.35 119.12 2a5m s TYR 10 Ca 0.12 -0.43 0.17 0.00 -1.01 0.00 0.00 57.07 55.92 2a5m s TYR 10 Cb -0.11 -1.33 0.83 0.00 -0.11 0.00 0.00 41.96 41.24 2a5m s TYR 10 CO 0.01 -0.06 1.84 0.93 -1.11 0.00 0.00 175.55 177.16 2a5m h GLU 11 N 5.68 0.00 -5.92 -0.62 5.08 -1.33 -0.30 114.58 117.17 2a5m h GLU 11 Ca -0.39 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.40 2a5m h GLU 11 Cb 1.14 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.30 2a5m h GLU 11 CO 0.47 0.34 -0.52 0.34 -1.00 0.00 0.00 179.01 178.65 2a5m s ASP 12 N -6.66 4.40 0.66 1.42 2.15 -0.56 -3.68 116.67 114.40 2a5m s ASP 12 Ca -0.02 -1.06 -0.13 0.00 0.43 0.00 0.00 52.55 51.78 2a5m s ASP 12 Cb 0.13 -0.50 -0.01 0.00 -0.30 0.00 0.00 42.92 42.24 2a5m s ASP 12 CO 0.69 -0.49 1.06 -0.13 -0.17 0.00 0.00 175.17 176.13 2a5m s ARG 13 N -3.87 3.09 -1.07 4.34 0.52 -1.26 -3.61 118.95 117.09 2a5m s ARG 13 Ca 0.40 1.03 -0.03 0.00 -0.52 0.00 0.00 55.73 56.61 2a5m s ARG 13 Cb 0.03 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.50 2a5m s ARG 13 CO 0.22 -0.98 0.40 0.09 0.02 0.00 0.00 175.30 175.05 2a5m n ASN 14 N -2.73 -4.67 -4.00 0.23 5.03 -0.32 -3.05 115.26 105.75 2a5m n ASN 14 Ca 0.08 -0.19 -0.30 0.00 0.87 0.00 0.00 54.58 55.05 2a5m n ASN 14 Cb 0.53 -3.54 -0.00 0.00 -1.02 0.00 0.00 39.78 35.74 2a5m n ASN 14 CO 0.00 0.00 0.00 2.22 -1.83 0.00 0.00 177.26 177.65 2a5m n PHE 15 N -4.11 -1.88 -4.12 3.10 1.16 -1.25 -4.98 117.46 105.39 2a5m n PHE 15 Ca -0.08 0.82 -0.24 0.00 -1.87 0.00 0.00 57.45 56.08 2a5m n PHE 15 Cb 0.59 -3.63 -0.07 0.00 -1.61 0.00 0.00 39.48 34.76 2a5m n PHE 15 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 2a5m s GLN 16 N -6.62 2.29 0.73 3.97 -0.21 -1.17 -5.01 119.66 113.63 2a5m s GLN 16 Ca 0.40 -1.67 0.00 0.00 0.02 0.00 0.00 55.36 54.12 2a5m s GLN 16 Cb -0.21 -2.09 0.00 0.00 1.00 0.00 0.00 33.01 31.71 2a5m s GLN 16 CO 0.88 0.03 0.00 0.41 -2.12 0.00 0.00 175.29 174.49 2a5m n GLY 17 N -1.16 -1.87 3.77 3.09 0.00 -1.26 -1.49 105.19 106.25 2a5m n GLY 17 Ca -0.02 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 2a5m n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2a5m s ARG 18 N 0.00 4.13 0.13 1.61 3.52 -1.26 -4.73 118.95 122.35 2a5m s ARG 18 Ca 0.00 1.97 0.10 0.00 -0.13 0.00 0.00 55.73 57.67 2a5m s ARG 18 Cb 0.00 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.55 2a5m s ARG 18 CO 0.00 -0.29 -0.25 0.50 -0.81 0.00 0.00 175.30 174.45 2a5m s ARG 19 N -2.12 1.33 -0.06 5.12 3.00 -1.26 -1.36 118.95 123.60 2a5m s ARG 19 Ca 0.55 -1.32 0.01 0.00 -1.00 0.00 0.00 55.73 53.96 2a5m s ARG 19 Cb -0.34 -1.73 0.02 0.00 0.00 0.00 0.00 34.95 32.90 2a5m s ARG 19 CO 0.43 0.40 -0.06 -0.47 0.00 0.00 0.00 175.30 175.61 2a5m s TYR 20 N -1.19 0.96 -0.09 5.12 5.04 -0.25 -4.98 117.35 121.96 2a5m s TYR 20 Ca 0.13 -0.33 0.01 0.00 -2.44 0.00 0.00 57.07 54.44 2a5m s TYR 20 Cb -0.10 -0.82 -0.03 0.00 0.35 0.00 0.00 41.96 41.36 2a5m s TYR 20 CO 0.06 -0.26 -0.09 0.16 -1.34 0.00 0.00 175.55 174.08 2a5m s ASP 21 N 1.07 4.40 -0.02 4.32 -4.77 -1.26 -1.03 116.67 119.37 2a5m s ASP 21 Ca -0.08 -0.14 0.03 0.00 -3.30 0.00 0.00 52.55 49.06 2a5m s ASP 21 Cb -0.14 -1.27 -0.00 0.00 -1.09 0.00 0.00 42.92 40.41 2a5m s ASP 21 CO -0.01 0.29 -0.11 0.00 0.70 0.00 0.00 175.17 176.04 2a5m n ASP 23 N 3.04 2.32 -3.43 0.00 5.68 -1.26 -1.99 116.55 120.91 2a5m n ASP 23 Ca -0.16 -2.01 -0.08 0.00 -0.50 0.00 0.00 54.79 52.03 2a5m n ASP 23 Cb 0.55 -0.08 -0.01 0.00 -1.14 0.00 0.00 41.12 40.44 2a5m n ASP 23 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2a5m s ASP 25 N -3.01 5.97 -0.14 0.00 2.15 -1.26 -4.73 116.67 115.65 2a5m s ASP 25 Ca 0.15 2.93 -0.01 0.00 0.43 0.00 0.00 52.55 56.05 2a5m s ASP 25 Cb -0.05 -2.66 0.04 0.00 -0.30 0.00 0.00 42.92 39.95 2a5m s ASP 25 CO 0.10 -1.11 -0.03 0.00 -0.17 0.00 0.00 175.17 173.96 2a5m h ALA 27 N 8.20 0.84 -1.50 0.00 0.00 -1.89 -1.64 119.26 123.28 2a5m h ALA 27 Ca -0.23 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.25 2a5m h ALA 27 Cb 1.12 -0.06 -0.26 0.00 0.00 0.00 0.00 17.79 18.59 2a5m h ALA 27 CO 0.36 0.45 -0.47 0.34 0.00 0.00 0.00 179.25 179.93 2a5m s ASP 28 N -6.35 -0.29 0.00 0.00 -1.08 -1.26 -4.05 116.67 103.64 2a5m s ASP 28 Ca 0.03 -0.04 0.18 0.00 -0.52 0.00 0.00 52.55 52.20 2a5m s ASP 28 Cb 0.08 1.43 0.46 0.00 -1.46 0.00 0.00 42.92 43.43 2a5m s ASP 28 CO 0.70 -0.32 1.37 2.22 0.52 0.00 0.00 175.17 179.66 2a5m n PHE 29 N 5.38 0.65 0.27 -5.34 -1.74 -1.25 -4.50 117.46 110.93 2a5m n PHE 29 Ca 0.01 -0.42 0.17 0.00 -0.56 0.00 0.00 57.45 56.65 2a5m n PHE 29 Cb 0.51 -0.01 0.93 0.00 1.52 0.00 0.00 39.48 42.43 2a5m n PHE 29 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2a5m h ARG 30 N 3.46 0.00 0.00 3.97 2.47 -1.83 0.47 114.38 122.91 2a5m h ARG 30 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2a5m h ARG 30 Cb 0.87 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.19 2a5m h ARG 30 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 179.97 181.30 2a5m h SER 31 N 0.00 0.00 0.00 7.04 0.02 -2.00 -3.14 113.55 115.47 2a5m h SER 31 Ca 0.03 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 2a5m h SER 31 Cb 0.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2a5m h SER 31 CO -0.00 0.00 -1.87 -1.22 -1.14 0.00 0.00 176.83 172.60 2a5m n TYR 32 N -2.63 0.00 -3.70 3.45 4.02 0.07 -4.96 117.16 113.41 2a5m n TYR 32 Ca 0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.81 2a5m n TYR 32 Cb 0.36 -0.49 -0.11 0.00 -0.02 0.00 0.00 39.34 39.08 2a5m n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2a5m s LEU 33 N -4.44 -0.03 0.00 7.72 2.96 -0.70 -4.83 118.68 119.37 2a5m s LEU 33 Ca -0.07 0.79 0.27 0.00 -0.22 0.00 0.00 54.13 54.90 2a5m s LEU 33 Cb 0.10 1.15 0.83 0.00 0.50 0.00 0.00 46.19 48.77 2a5m s LEU 33 CO 0.71 -0.19 1.64 -1.54 -1.32 0.00 0.00 176.35 175.65 2a5m n SER 34 N 4.42 0.28 -3.59 3.68 3.41 -1.26 -4.17 113.62 116.39 2a5m n SER 34 Ca -0.22 0.09 -0.04 0.00 -0.26 0.00 0.00 58.87 58.44 2a5m n SER 34 Cb 0.54 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.39 2a5m n SER 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a5m s ARG 35 N -3.00 0.59 -0.14 4.33 1.70 -1.26 -5.00 118.95 116.17 2a5m s ARG 35 Ca 0.12 -0.26 -0.04 0.00 -0.47 0.00 0.00 55.73 55.09 2a5m s ARG 35 Cb 0.18 0.24 0.07 0.00 -0.57 0.00 0.00 34.95 34.87 2a5m s ARG 35 CO 0.62 -0.26 0.18 0.00 -1.08 0.00 0.00 175.30 174.77 2a5m n ASN 37 N 5.32 2.48 -3.56 0.00 4.13 -0.13 -4.53 115.26 118.97 2a5m n ASN 37 Ca -0.05 -1.71 -0.14 0.00 1.68 0.00 0.00 54.58 54.36 2a5m n ASN 37 Cb 0.50 -0.06 -0.05 0.00 -1.54 0.00 0.00 39.78 38.63 2a5m n ASN 37 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2a5m s SER 38 N -1.24 -0.47 -0.02 6.41 1.04 -1.20 0.97 113.70 119.20 2a5m s SER 38 Ca 0.21 0.21 -0.09 0.00 0.48 0.00 0.00 55.95 56.75 2a5m s SER 38 Cb 0.14 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.77 2a5m s SER 38 CO 0.20 -0.73 0.20 -0.63 0.98 0.00 0.00 173.24 173.26 2a5m s ILE 39 N -2.43 0.06 -0.11 -1.02 1.01 -0.75 -1.51 121.20 116.45 2a5m s ILE 39 Ca -0.05 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.10 2a5m s ILE 39 Cb -0.01 -0.46 0.01 0.00 0.01 0.00 0.00 42.46 42.02 2a5m s ILE 39 CO -0.02 -0.28 -0.15 -0.60 0.00 0.00 0.00 174.94 173.89 2a5m s ARG 40 N -1.10 2.25 -0.31 2.79 3.52 0.69 -1.00 118.95 125.79 2a5m s ARG 40 Ca -0.12 -0.57 -0.08 0.00 -0.13 0.00 0.00 55.73 54.83 2a5m s ARG 40 Cb -0.06 -1.91 0.00 0.00 -1.56 0.00 0.00 34.95 31.43 2a5m s ARG 40 CO 0.02 -0.06 0.12 0.08 -0.81 0.00 0.00 175.30 174.65 2a5m s VAL 41 N 0.98 4.26 0.04 7.11 1.01 0.12 -0.25 120.40 133.66 2a5m s VAL 41 Ca -0.07 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 2a5m s VAL 41 Cb -0.15 -3.20 -0.27 0.00 0.00 0.00 0.00 36.38 32.77 2a5m s VAL 41 CO -0.02 0.06 0.98 -0.33 0.00 0.00 0.00 175.10 175.80 2a5m h GLU 42 N 8.29 0.20 -1.96 2.72 4.39 -1.40 -1.40 114.58 125.44 2a5m h GLU 42 Ca -0.31 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.04 2a5m h GLU 42 Cb 1.13 0.13 -0.19 0.00 -0.10 0.00 0.00 28.75 29.72 2a5m h GLU 42 CO 0.61 1.09 0.33 0.20 -1.16 0.00 0.00 179.01 180.08 2a5m s GLY 43 N -4.85 -0.47 0.00 -3.84 0.00 -1.22 -4.82 107.32 92.12 2a5m s GLY 43 Ca -0.06 1.46 0.00 0.00 0.00 0.00 0.00 44.72 46.12 2a5m s GLY 43 CO 0.86 0.88 0.00 0.61 0.00 0.00 0.00 173.10 175.44 2a5m n GLY 44 N 0.67 -1.26 3.75 0.20 0.00 -1.26 -1.84 105.19 105.44 2a5m n GLY 44 Ca -0.15 -1.59 -0.22 0.00 0.00 0.00 0.00 46.02 44.05 2a5m n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a5m s THR 45 N -1.49 3.76 -0.04 2.61 2.01 -1.24 -2.71 115.64 118.54 2a5m s THR 45 Ca 0.00 -1.64 -0.11 0.00 0.31 0.00 0.00 61.69 60.26 2a5m s THR 45 Cb 0.00 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.42 2a5m s THR 45 CO 0.00 -0.32 0.24 0.26 -0.69 0.00 0.00 174.62 174.12 2a5m s TRP 46 N -2.27 -0.15 -0.14 4.92 0.52 -0.29 -1.02 118.94 120.51 2a5m s TRP 46 Ca 0.34 0.29 -0.03 0.00 0.02 0.00 0.00 56.10 56.73 2a5m s TRP 46 Cb -0.06 0.05 -0.03 0.00 -1.15 0.00 0.00 33.47 32.28 2a5m s TRP 46 CO 0.23 -0.28 -0.05 0.00 0.02 0.00 0.00 176.95 176.87 2a5m s ALA 47 N -0.86 2.98 -0.00 0.98 0.00 -0.36 0.40 121.76 124.90 2a5m s ALA 47 Ca -0.09 -0.83 0.07 0.00 0.00 0.00 0.00 51.96 51.10 2a5m s ALA 47 Cb -0.05 -1.48 -0.03 0.00 0.00 0.00 0.00 23.12 21.57 2a5m s ALA 47 CO 0.02 0.29 -0.21 0.14 0.00 0.00 0.00 175.76 175.99 2a5m s VAL 48 N 0.14 2.48 0.03 0.00 -7.23 -0.39 -1.19 120.40 114.23 2a5m s VAL 48 Ca -0.02 -1.09 0.08 0.00 -1.81 0.00 0.00 61.98 59.15 2a5m s VAL 48 Cb -0.14 -1.95 -0.02 0.00 0.56 0.00 0.00 36.38 34.83 2a5m s VAL 48 CO 0.03 0.49 -0.24 -0.31 -0.31 0.00 0.00 175.10 174.76 2a5m s TYR 49 N -0.75 2.10 0.27 2.82 1.51 -0.27 -1.98 117.35 121.06 2a5m s TYR 49 Ca 0.12 -0.40 -0.00 0.00 -1.01 0.00 0.00 57.07 55.78 2a5m s TYR 49 Cb -0.10 -1.28 0.39 0.00 -0.11 0.00 0.00 41.96 40.85 2a5m s TYR 49 CO 0.01 0.07 1.77 1.49 -1.11 0.00 0.00 175.55 177.78 2a5m h GLU 50 N 5.02 0.70 -6.26 -0.62 4.57 -1.36 -1.58 114.58 115.05 2a5m h GLU 50 Ca -0.44 -0.19 -0.58 0.00 -1.18 0.00 0.00 59.36 56.96 2a5m h GLU 50 Cb 1.14 -0.08 -0.19 0.00 -0.16 0.00 0.00 28.75 29.46 2a5m h GLU 50 CO 0.45 0.75 -0.81 1.03 -1.18 0.00 0.00 179.01 179.24 2a5m s ARG 51 N -4.90 1.33 1.08 1.92 1.81 -0.58 -2.57 118.95 117.04 2a5m s ARG 51 Ca -0.09 -1.39 -0.18 0.00 -1.72 0.00 0.00 55.73 52.35 2a5m s ARG 51 Cb 0.15 -1.54 0.07 0.00 -0.45 0.00 0.00 34.95 33.17 2a5m s ARG 51 CO 0.80 0.33 -0.04 -2.30 -0.68 0.00 0.00 175.30 173.41 2a5m n PRO 52 N 0.48 -1.24 -3.10 3.54 -0.01 -1.26 -2.58 135.00 130.83 2a5m n PRO 52 Ca -0.15 -0.34 -0.19 0.00 -0.01 0.00 0.00 63.50 62.81 2a5m n PRO 52 Cb 0.56 -1.67 0.04 0.00 -0.01 0.00 0.00 33.50 32.42 2a5m n PRO 52 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 175.50 173.78 2a5m n ASN 53 N -1.18 -5.53 -4.03 2.55 2.85 -1.26 -3.09 115.26 105.57 2a5m n ASN 53 Ca 0.01 -0.32 -0.31 0.00 -0.11 0.00 0.00 54.58 53.85 2a5m n ASN 53 Cb 0.61 -4.28 -0.03 0.00 1.24 0.00 0.00 39.78 37.33 2a5m n ASN 53 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2a5m n PHE 54 N -4.43 -1.54 -4.40 1.20 3.72 -1.25 -4.96 117.46 105.80 2a5m n PHE 54 Ca -0.06 0.57 -0.20 0.00 -0.05 0.00 0.00 57.45 57.71 2a5m n PHE 54 Cb 0.58 -3.31 -0.10 0.00 -0.94 0.00 0.00 39.48 35.71 2a5m n PHE 54 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2a5m s SER 55 N -4.13 2.60 0.00 4.37 0.01 -1.07 -5.04 113.70 110.44 2a5m s SER 55 Ca 0.14 -1.16 0.00 0.00 1.31 0.00 0.00 55.95 56.24 2a5m s SER 55 Cb -0.06 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.03 2a5m s SER 55 CO 0.93 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.86 2a5m n GLY 56 N -0.52 -1.72 3.77 3.44 0.00 -1.26 -1.53 105.19 107.38 2a5m n GLY 56 Ca -0.06 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 2a5m n GLY 56 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2a5m s HIS 57 N 0.00 2.86 -0.06 1.61 3.76 -1.26 -4.68 115.29 117.52 2a5m s HIS 57 Ca 0.00 1.20 0.06 0.00 -0.15 0.00 0.00 55.06 56.16 2a5m s HIS 57 Cb 0.00 -3.86 -0.01 0.00 1.11 0.00 0.00 32.58 29.83 2a5m s HIS 57 CO 0.00 -2.55 -0.24 -1.64 -0.85 0.00 0.00 174.74 169.46 2a5m s MET 58 N -1.48 2.56 -0.01 1.40 1.00 -1.26 -1.74 119.30 119.77 2a5m s MET 58 Ca 0.54 -0.87 0.02 0.00 0.00 0.00 0.00 55.69 55.37 2a5m s MET 58 Cb -0.43 -2.13 -0.00 0.00 0.00 0.00 0.00 34.83 32.27 2a5m s MET 58 CO 0.54 0.34 -0.07 0.71 0.00 0.00 0.00 175.02 176.53 2a5m s TYR 59 N -0.07 0.68 -0.13 -0.03 2.02 -0.84 -2.34 117.35 116.64 2a5m s TYR 59 Ca -0.06 -0.13 -0.12 0.00 -0.37 0.00 0.00 57.07 56.39 2a5m s TYR 59 Cb -0.14 -0.45 -0.05 0.00 -0.40 0.00 0.00 41.96 40.92 2a5m s TYR 59 CO 0.04 -0.03 0.25 0.42 -1.57 0.00 0.00 175.55 174.66 2a5m s ILE 60 N -0.07 5.33 -0.23 2.71 1.09 -1.26 -1.26 121.20 127.51 2a5m s ILE 60 Ca 0.01 0.45 0.02 0.00 -1.10 0.00 0.00 60.65 60.04 2a5m s ILE 60 Cb -0.04 -3.56 0.05 0.00 -1.06 0.00 0.00 42.46 37.84 2a5m s ILE 60 CO -0.00 0.48 -0.13 -0.76 -0.10 0.00 0.00 174.94 174.42 2a5m s LEU 61 N -0.12 2.85 0.84 2.97 1.43 0.16 -4.96 118.68 121.84 2a5m s LEU 61 Ca 0.16 -1.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.05 2a5m s LEU 61 Cb -0.13 -1.47 0.09 0.00 0.03 0.00 0.00 46.19 44.72 2a5m s LEU 61 CO 0.04 -0.13 1.14 -2.16 0.23 0.00 0.00 176.35 175.48 2a5m s PRO 62 N 1.21 1.76 0.36 1.29 0.04 -1.26 -1.14 135.00 137.26 2a5m s PRO 62 Ca -0.04 0.29 -0.27 0.00 0.04 0.00 0.00 61.00 61.03 2a5m s PRO 62 Cb -0.17 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 2a5m s PRO 62 CO -0.08 -1.77 1.12 0.00 0.04 0.00 0.00 177.00 176.31 2a5m n GLN 63 N -3.47 1.64 -3.01 4.56 10.64 -1.10 -4.84 117.38 121.80 2a5m n GLN 63 Ca 0.07 0.58 0.00 0.00 -1.83 0.00 0.00 57.00 55.82 2a5m n GLN 63 Cb 0.59 -2.10 0.00 0.00 -0.86 0.00 0.00 30.24 27.87 2a5m n GLN 63 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2a5m n GLY 64 N 1.03 -1.56 3.24 2.61 0.00 -0.53 -4.98 105.19 105.01 2a5m n GLY 64 Ca 0.08 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 2a5m n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a5m s GLU 65 N -1.84 3.03 -0.36 1.61 2.12 -1.26 0.16 118.70 122.16 2a5m s GLU 65 Ca 0.00 -0.86 0.04 0.00 0.36 0.00 0.00 54.97 54.50 2a5m s GLU 65 Cb 0.00 -2.32 0.10 0.00 0.26 0.00 0.00 34.13 32.18 2a5m s GLU 65 CO 0.00 0.21 0.08 0.71 -0.54 0.00 0.00 175.26 175.72 2a5m s TYR 66 N 0.28 3.51 -1.66 5.30 1.51 -0.17 -4.98 117.35 121.14 2a5m s TYR 66 Ca -0.16 -2.92 0.16 0.00 -1.01 0.00 0.00 57.07 53.14 2a5m s TYR 66 Cb -0.17 -2.80 0.89 0.00 -0.11 0.00 0.00 41.96 39.76 2a5m s TYR 66 CO 0.08 -0.92 1.44 -0.35 -1.11 0.00 0.00 175.55 174.69 2a5m n PRO 67 N 4.16 0.35 -3.55 -1.71 -0.04 -1.26 -1.81 135.00 131.13 2a5m n PRO 67 Ca 0.04 0.08 -0.14 0.00 -0.04 0.00 0.00 63.50 63.44 2a5m n PRO 67 Cb 0.41 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.32 2a5m n PRO 67 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2a5m s GLU 68 N -2.34 1.07 0.27 0.54 2.02 -1.26 -1.18 118.70 117.82 2a5m s GLU 68 Ca 0.19 -0.22 -0.04 0.00 0.02 0.00 0.00 54.97 54.92 2a5m s GLU 68 Cb 0.11 0.49 0.32 0.00 0.10 0.00 0.00 34.13 35.16 2a5m s GLU 68 CO 0.22 -0.40 1.92 0.10 0.02 0.00 0.00 175.26 177.13 2a5m h TYR 69 N 2.69 1.15 -0.01 1.61 -0.00 0.30 -1.45 116.97 121.27 2a5m h TYR 69 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.43 2a5m h TYR 69 Cb 1.22 -0.38 -0.00 0.00 -0.00 0.00 0.00 36.73 37.57 2a5m h TYR 69 CO 0.34 0.76 0.01 1.96 -0.00 0.00 0.00 178.16 181.23 2a5m h GLN 70 N 1.22 0.00 0.00 0.10 4.20 -1.85 0.24 115.11 119.01 2a5m h GLN 70 Ca 0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.03 2a5m h GLN 70 Cb -0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.71 2a5m h GLN 70 CO -0.06 0.00 0.00 -0.09 -0.67 0.00 0.00 178.83 178.01 2a5m h ARG 71 N 0.00 0.00 -0.49 1.46 9.65 -1.65 -1.30 114.38 122.04 2a5m h ARG 71 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2a5m h ARG 71 Cb 0.03 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 2a5m h ARG 71 CO -0.00 0.00 0.00 1.87 2.80 0.00 0.00 179.97 184.64 2a5m n TRP 72 N -2.86 0.68 -1.80 2.20 -0.00 0.78 -4.93 117.44 111.51 2a5m n TRP 72 Ca 0.01 -0.51 -0.20 0.00 -0.00 0.00 0.00 57.50 56.80 2a5m n TRP 72 Cb 0.30 -0.03 -0.07 0.00 -0.00 0.00 0.00 31.31 31.51 2a5m n TRP 72 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 2a5m n MET 73 N 0.91 -1.52 -1.78 5.87 2.81 -0.49 -4.92 117.12 118.01 2a5m n MET 73 Ca 0.17 1.14 -0.39 0.00 -1.81 0.00 0.00 57.70 56.81 2a5m n MET 73 Cb 0.52 -5.60 0.03 0.00 -0.71 0.00 0.00 33.22 27.46 2a5m n MET 73 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2a5m s GLY 74 N -2.55 2.90 0.15 3.03 0.00 -0.86 -4.90 107.32 105.11 2a5m s GLY 74 Ca 0.00 1.40 0.08 0.00 0.00 0.00 0.00 44.72 46.20 2a5m s GLY 74 CO 0.00 1.95 1.34 -2.00 0.00 0.00 0.00 173.10 174.40 2a5m h LEU 75 N 1.78 0.00 0.00 0.66 5.85 -1.91 -3.43 115.31 118.27 2a5m h LEU 75 Ca -0.51 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 2a5m h LEU 75 Cb 1.29 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2a5m h LEU 75 CO 0.59 0.91 0.02 -0.46 -0.34 0.00 0.00 178.44 179.15 2a5m n ASN 76 N -3.41 -0.22 -2.06 1.25 2.04 -1.26 -5.04 115.26 106.56 2a5m n ASN 76 Ca -0.00 -1.17 -0.17 0.00 -0.44 0.00 0.00 54.58 52.80 2a5m n ASN 76 Cb 0.88 0.37 0.20 0.00 -2.53 0.00 0.00 39.78 38.70 2a5m n ASN 76 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 2a5m n ASP 77 N -1.27 3.97 -4.64 0.53 8.00 -1.26 -4.92 116.55 116.96 2a5m n ASP 77 Ca -0.01 -3.36 -0.38 0.00 0.71 0.00 0.00 54.79 51.76 2a5m n ASP 77 Cb 0.06 -0.79 -0.09 0.00 -0.02 0.00 0.00 41.12 40.28 2a5m n ASP 77 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2a5m s ARG 78 N -2.93 4.05 -0.10 -1.24 1.81 -1.26 -2.48 118.95 116.80 2a5m s ARG 78 Ca 0.51 -0.13 -0.04 0.00 -1.72 0.00 0.00 55.73 54.36 2a5m s ARG 78 Cb 0.43 -3.59 0.05 0.00 -0.45 0.00 0.00 34.95 31.39 2a5m s ARG 78 CO 0.11 -0.08 0.19 -0.51 -0.68 0.00 0.00 175.30 174.34 2a5m s LEU 79 N 1.46 -0.04 -0.01 2.53 1.43 -1.26 -4.50 118.68 118.29 2a5m s LEU 79 Ca 0.11 0.42 0.15 0.00 -1.03 0.00 0.00 54.13 53.78 2a5m s LEU 79 Cb -0.15 0.44 -0.20 0.00 0.03 0.00 0.00 46.19 46.31 2a5m s LEU 79 CO 0.08 -0.23 0.42 0.61 0.23 0.00 0.00 176.35 177.46 2a5m n GLY 80 N 5.16 -0.55 3.36 -3.19 0.00 -0.60 -4.85 105.19 104.51 2a5m n GLY 80 Ca -0.08 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.43 2a5m n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a5m s SER 81 N -3.21 -0.37 -0.01 1.61 1.04 -1.16 -3.82 113.70 107.77 2a5m s SER 81 Ca -0.01 0.11 -0.07 0.00 0.48 0.00 0.00 55.95 56.45 2a5m s SER 81 Cb 0.10 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.69 2a5m s SER 81 CO 0.60 -0.69 0.15 0.00 0.98 0.00 0.00 173.24 174.27 2a5m s ARG 83 N -1.01 0.65 0.02 0.00 0.52 -0.34 -0.98 118.95 117.82 2a5m s ARG 83 Ca -0.11 -0.29 -0.30 0.00 -0.52 0.00 0.00 55.73 54.51 2a5m s ARG 83 Cb -0.06 -0.62 -0.04 0.00 0.52 0.00 0.00 34.95 34.74 2a5m s ARG 83 CO 0.01 0.17 1.13 0.00 0.02 0.00 0.00 175.30 176.64 2a5m s ALA 84 N -0.20 3.34 -0.21 2.13 0.00 -1.26 -1.23 121.76 124.33 2a5m s ALA 84 Ca 0.03 0.72 -0.18 0.00 0.00 0.00 0.00 51.96 52.53 2a5m s ALA 84 Cb -0.03 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.63 2a5m s ALA 84 CO -0.00 -0.43 0.51 0.08 0.00 0.00 0.00 175.76 175.92 2a5m s VAL 85 N 1.23 5.11 -0.00 0.00 1.01 -0.19 -4.87 120.40 122.69 2a5m s VAL 85 Ca 0.56 0.93 -0.18 0.00 0.00 0.00 0.00 61.98 63.29 2a5m s VAL 85 Cb -0.26 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 2a5m s VAL 85 CO 0.28 0.17 0.52 -1.00 0.00 0.00 0.00 175.10 175.06 2a5m s HIS 86 N 1.71 3.70 -0.13 5.22 3.76 -1.26 -3.69 115.29 124.59 2a5m s HIS 86 Ca 0.23 1.11 -0.09 0.00 -0.15 0.00 0.00 55.06 56.17 2a5m s HIS 86 Cb -0.15 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 31.01 2a5m s HIS 86 CO 0.09 0.46 0.17 -0.51 -0.85 0.00 0.00 174.74 174.10 2a5m s LEU 87 N -0.51 4.35 -0.17 0.89 1.43 -1.26 -4.57 118.68 118.84 2a5m s LEU 87 Ca 0.28 0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 53.82 2a5m s LEU 87 Cb -0.18 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 43.90 2a5m s LEU 87 CO 0.15 0.34 -0.08 -0.55 0.23 0.00 0.00 176.35 176.44 2a5m s SER 88 N -0.68 4.28 0.00 2.29 0.15 -1.26 -5.03 113.70 113.45 2a5m s SER 88 Ca 0.14 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.49 2a5m s SER 88 Cb -0.12 -1.69 0.00 0.00 -1.71 0.00 0.00 66.02 62.49 2a5m s SER 88 CO 0.04 0.10 0.00 -0.24 1.20 0.00 0.00 173.24 174.34 2a5m n SER 89 N 3.96 0.18 0.00 5.45 2.88 -1.26 -4.78 113.62 120.05 2a5m n SER 89 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 2a5m n SER 89 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2a5m n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2a5m n GLY 90 N 5.00 3.88 0.00 0.46 0.00 -1.26 -5.03 105.19 108.24 2a5m n GLY 90 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 2a5m n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a5m n GLY 91 N 0.00 -1.70 3.09 -0.02 0.00 -1.26 -5.12 105.19 100.19 2a5m n GLY 91 Ca 0.00 0.79 -0.32 0.00 0.00 0.00 0.00 46.02 46.49 2a5m n GLY 91 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a5m s GLN 92 N 0.00 2.75 0.03 1.61 -0.44 -1.26 -5.10 119.66 117.24 2a5m s GLN 92 Ca 0.00 -0.84 -0.30 0.00 -2.50 0.00 0.00 55.36 51.71 2a5m s GLN 92 Cb 0.00 -2.52 -0.04 0.00 -1.64 0.00 0.00 33.01 28.80 2a5m s GLN 92 CO 0.00 -0.27 1.10 0.00 0.50 0.00 0.00 175.29 176.63 2a5m s ALA 93 N 1.31 3.30 -0.01 1.58 0.00 -1.26 -5.03 121.76 121.64 2a5m s ALA 93 Ca 0.03 0.69 0.04 0.00 0.00 0.00 0.00 51.96 52.73 2a5m s ALA 93 Cb -0.14 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 2a5m s ALA 93 CO -0.12 -0.37 -0.13 0.21 0.00 0.00 0.00 175.76 175.36 2a5m s LYS 94 N 1.12 1.08 0.04 0.00 2.20 -1.26 -4.59 119.74 118.33 2a5m s LYS 94 Ca 0.55 -0.46 0.05 0.00 -0.36 0.00 0.00 55.97 55.76 2a5m s LYS 94 Cb -0.25 -1.04 -0.02 0.00 -1.51 0.00 0.00 37.83 35.01 2a5m s LYS 94 CO 0.28 0.27 -0.15 -1.50 -0.36 0.00 0.00 175.35 173.89 2a5m s ILE 95 N -0.25 1.19 -0.07 5.43 2.07 -0.89 -3.58 121.20 125.09 2a5m s ILE 95 Ca 0.04 -1.04 0.05 0.00 -1.41 0.00 0.00 60.65 58.29 2a5m s ILE 95 Cb -0.06 -1.07 -0.00 0.00 0.13 0.00 0.00 42.46 41.46 2a5m s ILE 95 CO -0.00 0.02 -0.23 0.00 -1.91 0.00 0.00 174.94 172.82 2a5m s GLN 96 N -1.17 2.58 0.07 3.50 -2.07 -1.02 -1.79 119.66 119.76 2a5m s GLN 96 Ca 0.02 -0.84 0.08 0.00 -1.82 0.00 0.00 55.36 52.81 2a5m s GLN 96 Cb -0.08 -2.10 -0.03 0.00 -1.09 0.00 0.00 33.01 29.71 2a5m s GLN 96 CO 0.01 0.28 -0.22 0.14 -1.32 0.00 0.00 175.29 174.18 2a5m s VAL 97 N 0.07 1.83 -0.00 3.63 -7.23 -0.22 -1.11 120.40 117.37 2a5m s VAL 97 Ca -0.09 -1.38 0.08 0.00 -1.81 0.00 0.00 61.98 58.78 2a5m s VAL 97 Cb -0.15 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 2a5m s VAL 97 CO 0.05 0.16 -0.26 -0.36 -0.31 0.00 0.00 175.10 174.38 2a5m s PHE 98 N -0.92 2.35 0.39 2.82 0.40 -0.88 -1.46 117.98 120.68 2a5m s PHE 98 Ca 0.09 -0.42 0.15 0.00 -0.60 0.00 0.00 56.93 56.15 2a5m s PHE 98 Cb -0.09 -1.47 0.88 0.00 0.51 0.00 0.00 43.02 42.84 2a5m s PHE 98 CO 0.03 0.02 1.90 1.49 0.70 0.00 0.00 175.22 179.36 2a5m h GLU 99 N 5.26 0.00 -5.80 0.44 4.81 -1.15 -3.37 114.58 114.77 2a5m h GLU 99 Ca -0.44 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.19 2a5m h GLU 99 Cb 1.13 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.40 2a5m h GLU 99 CO 0.46 0.29 -0.55 0.15 -0.73 0.00 0.00 179.01 178.64 2a5m s LYS 100 N -4.29 2.10 0.90 1.92 -0.14 0.14 -4.57 119.74 115.80 2a5m s LYS 100 Ca -0.03 -1.96 -0.12 0.00 -1.36 0.00 0.00 55.97 52.51 2a5m s LYS 100 Cb 0.14 -1.83 0.13 0.00 -1.68 0.00 0.00 37.83 34.59 2a5m s LYS 100 CO 0.70 -0.08 1.09 0.20 -0.76 0.00 0.00 175.35 176.50 2a5m s GLY 101 N -3.81 1.61 -1.46 -3.33 0.00 -1.26 -3.46 107.32 95.61 2a5m s GLY 101 Ca 0.38 -0.09 -0.10 0.00 0.00 0.00 0.00 44.72 44.92 2a5m s GLY 101 CO 0.20 0.40 0.92 1.34 0.00 0.00 0.00 173.10 175.97 2a5m n ASP 102 N -3.88 -5.59 -3.71 1.64 -0.08 -1.23 -2.77 116.55 100.91 2a5m n ASP 102 Ca 0.07 -0.54 -0.25 0.00 -1.51 0.00 0.00 54.79 52.56 2a5m n ASP 102 Cb 0.55 -4.46 0.03 0.00 2.34 0.00 0.00 41.12 39.58 2a5m n ASP 102 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2a5m n PHE 103 N -4.69 -1.89 -4.38 -0.67 3.72 -1.25 -5.00 117.46 103.30 2a5m n PHE 103 Ca -0.01 0.68 -0.19 0.00 -0.05 0.00 0.00 57.45 57.88 2a5m n PHE 103 Cb 0.56 -3.88 -0.10 0.00 -0.94 0.00 0.00 39.48 35.12 2a5m n PHE 103 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2a5m s ASN 104 N -3.96 2.17 0.00 4.37 3.84 -1.12 -5.03 114.94 115.21 2a5m s ASN 104 Ca 0.21 -1.24 0.00 0.00 0.21 0.00 0.00 52.86 52.04 2a5m s ASN 104 Cb -0.07 -0.05 0.00 0.00 -0.55 0.00 0.00 41.25 40.58 2a5m s ASN 104 CO 0.84 -0.48 0.00 0.61 -2.79 0.00 0.00 177.10 175.28 2a5m n GLY 105 N -0.51 -1.79 3.77 1.21 0.00 -1.26 -0.68 105.19 105.93 2a5m n GLY 105 Ca -0.05 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.84 2a5m n GLY 105 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a5m s GLN 106 N 0.00 4.35 0.01 1.61 2.00 -1.26 -4.70 119.66 121.67 2a5m s GLN 106 Ca 0.00 1.59 0.07 0.00 -2.00 0.00 0.00 55.36 55.02 2a5m s GLN 106 Cb 0.00 -2.78 -0.03 0.00 0.80 0.00 0.00 33.01 31.00 2a5m s GLN 106 CO 0.00 0.01 -0.19 1.41 -0.50 0.00 0.00 175.29 176.02 2a5m s MET 107 N -2.10 2.15 -0.02 1.67 -2.45 -1.26 -1.07 119.30 116.22 2a5m s MET 107 Ca 0.53 -0.92 0.03 0.00 -1.25 0.00 0.00 55.69 54.08 2a5m s MET 107 Cb -0.25 -2.18 0.00 0.00 1.25 0.00 0.00 34.83 33.65 2a5m s MET 107 CO 0.32 0.56 -0.10 0.71 1.05 0.00 0.00 175.02 177.56 2a5m s TYR 108 N -0.81 1.01 -0.07 4.11 2.02 -0.53 -4.97 117.35 118.11 2a5m s TYR 108 Ca 0.13 -0.25 0.05 0.00 -0.37 0.00 0.00 57.07 56.63 2a5m s TYR 108 Cb -0.10 -0.71 -0.01 0.00 -0.40 0.00 0.00 41.96 40.74 2a5m s TYR 108 CO 0.03 -0.09 -0.22 -2.00 -1.57 0.00 0.00 175.55 171.69 2a5m s GLU 109 N 0.12 2.69 -0.01 -0.62 -6.30 -1.26 -1.06 118.70 112.25 2a5m s GLU 109 Ca -0.02 -0.85 -0.14 0.00 -2.50 0.00 0.00 54.97 51.46 2a5m s GLU 109 Cb -0.08 -2.26 0.02 0.00 0.00 0.00 0.00 34.13 31.81 2a5m s GLU 109 CO 0.00 0.37 0.29 -0.08 0.02 0.00 0.00 175.26 175.87 2a5m s THR 110 N -0.13 0.06 -0.99 -1.70 -1.32 -0.74 -5.01 115.64 105.82 2a5m s THR 110 Ca -0.04 -0.52 0.11 0.00 -1.21 0.00 0.00 61.69 60.04 2a5m s THR 110 Cb -0.14 -0.63 0.33 0.00 -1.51 0.00 0.00 72.50 70.55 2a5m s THR 110 CO 0.04 -0.28 1.27 0.35 -2.21 0.00 0.00 174.62 173.79 2a5m n THR 111 N 1.22 1.00 -4.50 5.08 -2.24 -1.26 -2.10 114.28 111.47 2a5m n THR 111 Ca -0.21 -1.00 -0.25 0.00 -2.27 0.00 0.00 64.05 60.32 2a5m n THR 111 Cb 0.56 0.50 -0.10 0.00 -2.10 0.00 0.00 70.33 69.19 2a5m n THR 111 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2a5m s GLU 112 N -1.00 1.73 0.71 -0.78 0.41 -1.26 -4.89 118.70 113.62 2a5m s GLU 112 Ca 0.25 -1.86 -0.14 0.00 -0.41 0.00 0.00 54.97 52.80 2a5m s GLU 112 Cb 0.13 -1.65 0.03 0.00 -1.78 0.00 0.00 34.13 30.85 2a5m s GLU 112 CO 0.17 0.19 1.15 -0.51 -0.49 0.00 0.00 175.26 175.77 2a5m s ASP 113 N -3.55 4.56 -0.25 -0.19 1.11 -1.26 -4.95 116.67 112.14 2a5m s ASP 113 Ca 0.31 2.15 0.02 0.00 0.18 0.00 0.00 52.55 55.21 2a5m s ASP 113 Cb 0.00 -2.57 0.06 0.00 1.07 0.00 0.00 42.92 41.49 2a5m s ASP 113 CO 0.15 -2.01 -0.08 0.00 1.18 0.00 0.00 175.17 174.42 2a5m h PRO 115 N 7.87 0.13 -2.89 0.00 0.13 -1.88 -2.38 132.00 132.98 2a5m h PRO 115 Ca -0.18 -0.15 -0.45 0.00 -0.87 0.00 0.00 66.00 64.35 2a5m h PRO 115 Cb 1.06 0.05 -0.40 0.00 0.13 0.00 0.00 31.00 31.83 2a5m h PRO 115 CO 0.43 0.93 -0.74 0.45 -0.23 0.00 0.00 178.00 178.85 2a5m s SER 116 N -6.88 2.45 0.22 1.44 0.15 -1.26 -2.09 113.70 107.74 2a5m s SER 116 Ca -0.02 -0.71 -0.07 0.00 0.70 0.00 0.00 55.95 55.85 2a5m s SER 116 Cb 0.10 -0.15 0.20 0.00 -1.71 0.00 0.00 66.02 64.46 2a5m s SER 116 CO 0.82 -0.37 1.78 0.40 1.20 0.00 0.00 173.24 177.07 2a5m h ILE 117 N 6.40 1.26 -0.46 6.45 2.04 -1.43 -1.79 117.51 129.98 2a5m h ILE 117 Ca -0.16 -0.85 -0.09 0.00 1.00 0.00 0.00 64.86 64.76 2a5m h ILE 117 Cb 1.12 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 2a5m h ILE 117 CO 0.32 0.34 -0.09 -0.03 0.00 0.00 0.00 178.15 178.69 2a5m h MET 118 N 1.09 0.82 -0.28 2.37 4.05 -1.82 0.35 114.93 121.51 2a5m h MET 118 Ca 0.24 -0.26 -0.18 0.00 -0.28 0.00 0.00 59.70 59.22 2a5m h MET 118 Cb 0.25 -0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 30.98 2a5m h MET 118 CO -0.01 0.88 -0.54 1.49 0.23 0.00 0.00 176.91 178.95 2a5m h GLU 119 N 0.74 0.83 0.05 0.39 4.22 -1.83 0.54 114.58 119.52 2a5m h GLU 119 Ca 0.13 -0.52 -0.09 0.00 0.08 0.00 0.00 59.36 58.96 2a5m h GLU 119 Cb 0.57 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.89 2a5m h GLU 119 CO 0.04 1.15 -0.40 0.37 -2.18 0.00 0.00 179.01 177.99 2a5m h GLN 120 N 0.64 0.11 -0.01 1.92 5.75 -1.11 -3.39 115.11 119.01 2a5m h GLN 120 Ca 0.02 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.32 2a5m h GLN 120 Cb 1.14 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.76 2a5m h GLN 120 CO 0.12 1.09 -0.09 1.19 -2.65 0.00 0.00 178.83 178.49 2a5m n PHE 121 N -4.41 0.00 -2.81 3.99 3.72 0.12 -4.98 117.46 113.09 2a5m n PHE 121 Ca -0.13 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.07 2a5m n PHE 121 Cb 0.63 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.19 2a5m n PHE 121 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 2a5m n HIS 122 N 0.24 -1.59 -4.88 1.38 8.25 0.18 -4.96 115.22 113.85 2a5m n HIS 122 Ca 0.05 0.37 -0.33 0.00 -0.26 0.00 0.00 57.72 57.55 2a5m n HIS 122 Cb 0.24 -4.10 -0.14 0.00 1.12 0.00 0.00 29.99 27.12 2a5m n HIS 122 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2a5m s LEU 123 N -5.98 2.67 0.20 2.41 1.43 -1.24 -4.95 118.68 113.22 2a5m s LEU 123 Ca 0.21 -0.28 0.21 0.00 -1.03 0.00 0.00 54.13 53.25 2a5m s LEU 123 Cb -0.09 -1.56 -0.00 0.00 0.03 0.00 0.00 46.19 44.56 2a5m s LEU 123 CO 0.26 0.26 1.05 0.03 0.23 0.00 0.00 176.35 178.19 2a5m h ARG 124 N 5.95 0.00 -3.87 1.70 -0.00 -1.94 -3.18 114.38 113.04 2a5m h ARG 124 Ca -0.37 0.00 -0.10 0.00 -0.50 0.00 0.00 59.98 59.01 2a5m h ARG 124 Cb 1.18 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 31.02 2a5m h ARG 124 CO 0.52 0.06 -0.34 -1.21 0.00 0.00 0.00 179.97 179.01 2a5m s GLU 125 N -3.26 1.08 -0.11 0.04 8.01 -1.26 -4.64 118.70 118.55 2a5m s GLU 125 Ca -0.00 -1.12 0.01 0.00 0.01 0.00 0.00 54.97 53.86 2a5m s GLU 125 Cb 0.09 0.37 0.02 0.00 -4.31 0.00 0.00 34.13 30.30 2a5m s GLU 125 CO 0.78 -0.38 -0.12 0.42 0.01 0.00 0.00 175.26 175.97 2a5m s ILE 126 N -3.94 1.31 -0.32 -1.63 -1.09 -0.82 -4.94 121.20 109.76 2a5m s ILE 126 Ca 0.14 -0.52 0.10 0.00 -2.23 0.00 0.00 60.65 58.15 2a5m s ILE 126 Cb 0.04 -1.23 -0.13 0.00 -1.58 0.00 0.00 42.46 39.56 2a5m s ILE 126 CO -0.03 0.41 0.37 1.41 -1.23 0.00 0.00 174.94 175.87 2a5m n HIS 127 N 4.39 0.00 -3.51 3.97 8.25 -1.26 -4.63 115.22 122.43 2a5m n HIS 127 Ca -0.18 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.12 2a5m n HIS 127 Cb 0.51 -0.08 -0.05 0.00 1.12 0.00 0.00 29.99 31.48 2a5m n HIS 127 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2a5m s SER 128 N -2.41 -0.62 -0.23 0.41 0.15 -1.26 -3.88 113.70 105.86 2a5m s SER 128 Ca 0.01 0.58 -0.27 0.00 0.70 0.00 0.00 55.95 56.97 2a5m s SER 128 Cb 0.07 0.53 0.13 0.00 -1.71 0.00 0.00 66.02 65.04 2a5m s SER 128 CO 0.43 -0.64 1.04 0.00 1.20 0.00 0.00 173.24 175.26 2a5m s LYS 130 N -0.31 1.73 -0.08 0.00 2.36 -0.27 -4.33 119.74 118.85 2a5m s LYS 130 Ca 0.01 -1.09 0.01 0.00 -2.55 0.00 0.00 55.97 52.35 2a5m s LYS 130 Cb -0.03 -2.66 -0.03 0.00 -1.05 0.00 0.00 37.83 34.06 2a5m s LYS 130 CO -0.04 -0.61 -0.08 0.54 1.55 0.00 0.00 175.35 176.72 2a5m s VAL 131 N 1.33 3.59 -0.42 4.02 0.11 -1.26 -2.45 120.40 125.32 2a5m s VAL 131 Ca -0.06 -0.51 0.02 0.00 -2.93 0.00 0.00 61.98 58.50 2a5m s VAL 131 Cb -0.19 -2.48 0.12 0.00 -1.53 0.00 0.00 36.38 32.31 2a5m s VAL 131 CO -0.06 0.58 0.20 -0.69 -3.33 0.00 0.00 175.10 171.79 2a5m s VAL 132 N -0.55 1.65 0.00 2.04 1.01 -1.23 -4.74 120.40 118.58 2a5m s VAL 132 Ca 0.08 -2.49 0.00 0.00 0.00 0.00 0.00 61.98 59.58 2a5m s VAL 132 Cb -0.12 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.09 2a5m s VAL 132 CO 0.02 -0.80 0.00 1.21 0.00 0.00 0.00 175.10 175.52 2a5m n GLU 133 N 3.76 0.00 0.00 2.72 2.13 -1.26 -4.54 120.64 123.45 2a5m n GLU 133 Ca 0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.87 2a5m n GLU 133 Cb 0.36 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.07 2a5m n GLU 133 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2a5m n GLY 134 N 0.43 -1.97 3.09 8.31 0.00 -1.26 -4.80 105.19 108.98 2a5m n GLY 134 Ca 0.00 0.66 -0.30 0.00 0.00 0.00 0.00 46.02 46.38 2a5m n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2a5m s THR 135 N 0.00 1.69 0.11 2.61 -4.23 -1.26 -2.51 115.64 112.04 2a5m s THR 135 Ca 0.00 -0.75 0.07 0.00 -1.18 0.00 0.00 61.69 59.83 2a5m s THR 135 Cb 0.00 -1.53 -0.03 0.00 1.34 0.00 0.00 72.50 72.28 2a5m s THR 135 CO 0.00 0.48 -0.18 0.26 -0.54 0.00 0.00 174.62 174.64 2a5m s TRP 136 N 1.02 1.60 -0.09 3.99 0.52 -0.89 -2.24 118.94 122.85 2a5m s TRP 136 Ca -0.05 -0.45 0.03 0.00 0.02 0.00 0.00 56.10 55.65 2a5m s TRP 136 Cb -0.15 -0.86 -0.01 0.00 -1.15 0.00 0.00 33.47 31.30 2a5m s TRP 136 CO -0.03 0.18 -0.19 0.42 0.02 0.00 0.00 176.95 177.34 2a5m s ILE 137 N -1.45 2.53 -0.04 2.03 1.01 -0.19 -0.50 121.20 124.60 2a5m s ILE 137 Ca 0.06 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.85 2a5m s ILE 137 Cb -0.09 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 2a5m s ILE 137 CO 0.04 0.56 -0.09 -0.36 0.00 0.00 0.00 174.94 175.09 2a5m s PHE 138 N -0.02 2.87 0.02 3.97 0.40 -0.18 -0.92 117.98 124.11 2a5m s PHE 138 Ca -0.06 -0.04 0.08 0.00 -0.60 0.00 0.00 56.93 56.31 2a5m s PHE 138 Cb -0.15 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 2a5m s PHE 138 CO 0.05 0.31 -0.22 0.71 0.70 0.00 0.00 175.22 176.76 2a5m s TYR 139 N -0.84 1.98 0.24 0.36 1.51 0.11 -0.44 117.35 120.27 2a5m s TYR 139 Ca 0.13 -0.38 0.09 0.00 -1.01 0.00 0.00 57.07 55.90 2a5m s TYR 139 Cb -0.11 -1.22 0.24 0.00 -0.11 0.00 0.00 41.96 40.76 2a5m s TYR 139 CO 0.03 0.05 1.54 1.49 -1.11 0.00 0.00 175.55 177.55 2a5m h GLU 140 N 5.12 0.04 -6.46 -0.62 4.81 -1.40 -1.59 114.58 114.47 2a5m h GLU 140 Ca -0.42 -0.03 -0.63 0.00 -0.13 0.00 0.00 59.36 58.14 2a5m h GLU 140 Cb 1.15 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.38 2a5m h GLU 140 CO 0.45 0.71 -0.74 -0.51 -0.73 0.00 0.00 179.01 178.19 2a5m s LEU 141 N -7.50 2.84 1.10 1.64 1.43 -0.27 -3.32 118.68 114.60 2a5m s LEU 141 Ca -0.01 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.27 2a5m s LEU 141 Cb 0.12 -1.52 0.18 0.00 0.03 0.00 0.00 46.19 45.00 2a5m s LEU 141 CO 0.78 0.10 0.63 -0.81 0.23 0.00 0.00 176.35 177.28 2a5m n PRO 142 N 0.02 -1.71 -2.57 1.29 -0.04 -1.26 -2.53 135.00 128.20 2a5m n PRO 142 Ca -0.11 -0.47 -0.21 0.00 -0.04 0.00 0.00 63.50 62.67 2a5m n PRO 142 Cb 0.56 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 2a5m n PRO 142 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2a5m n ASN 143 N -3.39 -5.97 -3.51 3.54 2.85 -0.89 -2.88 115.26 105.00 2a5m n ASN 143 Ca 0.04 -0.09 -0.19 0.00 -0.11 0.00 0.00 54.58 54.23 2a5m n ASN 143 Cb 0.56 -4.93 0.06 0.00 1.24 0.00 0.00 39.78 36.72 2a5m n ASN 143 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2a5m n TYR 144 N -4.14 -2.11 -4.41 1.20 4.01 -1.23 -5.02 117.16 105.45 2a5m n TYR 144 Ca -0.21 0.87 -0.21 0.00 -0.16 0.00 0.00 57.90 58.19 2a5m n TYR 144 Cb 0.67 -4.62 -0.10 0.00 -0.31 0.00 0.00 39.34 34.97 2a5m n TYR 144 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2a5m s ARG 145 N -5.48 1.51 0.83 -0.72 1.81 -1.05 -5.02 118.95 110.83 2a5m s ARG 145 Ca 0.09 -1.76 0.00 0.00 -1.72 0.00 0.00 55.73 52.33 2a5m s ARG 145 Cb -0.02 -1.07 0.00 0.00 -0.45 0.00 0.00 34.95 33.42 2a5m s ARG 145 CO 0.77 0.02 0.00 0.41 -0.68 0.00 0.00 175.30 175.81 2a5m n GLY 146 N -0.55 -1.81 3.77 -3.53 0.00 -1.26 -1.12 105.19 100.69 2a5m n GLY 146 Ca -0.05 -1.66 -0.40 0.00 0.00 0.00 0.00 46.02 43.91 2a5m n GLY 146 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2a5m s ARG 147 N 0.00 4.24 0.08 1.61 3.52 -1.26 -4.73 118.95 122.40 2a5m s ARG 147 Ca 0.00 2.03 0.07 0.00 -0.13 0.00 0.00 55.73 57.70 2a5m s ARG 147 Cb 0.00 -2.91 -0.04 0.00 -1.56 0.00 0.00 34.95 30.44 2a5m s ARG 147 CO 0.00 -0.22 -0.11 -0.65 -0.81 0.00 0.00 175.30 173.50 2a5m s GLN 148 N -1.97 2.16 -0.06 5.12 -0.21 -0.99 -1.80 119.66 121.91 2a5m s GLN 148 Ca 0.52 -0.98 0.05 0.00 0.02 0.00 0.00 55.36 54.97 2a5m s GLN 148 Cb -0.36 -2.30 -0.00 0.00 1.00 0.00 0.00 33.01 31.35 2a5m s GLN 148 CO 0.46 0.53 -0.20 0.71 -2.12 0.00 0.00 175.29 174.66 2a5m s TYR 149 N -1.12 2.06 -0.25 0.91 2.02 0.41 -4.44 117.35 116.94 2a5m s TYR 149 Ca 0.19 -0.66 -0.14 0.00 -0.37 0.00 0.00 57.07 56.09 2a5m s TYR 149 Cb -0.11 -1.38 -0.04 0.00 -0.40 0.00 0.00 41.96 40.03 2a5m s TYR 149 CO 0.11 -0.23 0.32 -1.17 -1.57 0.00 0.00 175.55 173.01 2a5m s LEU 150 N 0.08 4.07 -0.05 -1.29 2.96 -1.26 -1.01 118.68 122.16 2a5m s LEU 150 Ca -0.07 0.27 -0.12 0.00 -0.22 0.00 0.00 54.13 53.98 2a5m s LEU 150 Cb -0.14 -2.36 -0.05 0.00 0.50 0.00 0.00 46.19 44.15 2a5m s LEU 150 CO 0.04 -0.11 0.31 -0.76 -1.32 0.00 0.00 176.35 174.51 2a5m s LEU 151 N 1.75 4.43 0.00 -0.68 1.02 0.35 -4.95 118.68 120.59 2a5m s LEU 151 Ca 0.14 0.76 0.00 0.00 0.02 0.00 0.00 54.13 55.05 2a5m s LEU 151 Cb -0.15 -2.40 0.00 0.00 0.02 0.00 0.00 46.19 43.66 2a5m s LEU 151 CO 0.09 0.33 0.00 -0.90 0.02 0.00 0.00 176.35 175.89 2a5m n ASP 152 N 2.03 0.56 -1.56 2.29 5.68 -1.26 -2.09 116.55 122.20 2a5m n ASP 152 Ca -0.16 -0.83 -0.04 0.00 -0.50 0.00 0.00 54.79 53.26 2a5m n ASP 152 Cb 0.53 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.52 2a5m n ASP 152 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2a5m n LYS 153 N -0.60 1.21 -4.23 0.11 2.85 -1.05 -4.78 118.16 111.67 2a5m n LYS 153 Ca 0.00 -0.42 -0.28 0.00 -1.05 0.00 0.00 58.31 56.57 2a5m n LYS 153 Cb 0.00 -1.16 -0.05 0.00 -0.65 0.00 0.00 35.03 33.16 2a5m n LYS 153 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2a5m s LYS 154 N -0.48 2.22 -0.21 -1.58 1.02 -1.26 -5.03 119.74 114.42 2a5m s LYS 154 Ca 0.08 -2.06 -0.07 0.00 0.02 0.00 0.00 55.97 53.94 2a5m s LYS 154 Cb 0.07 -1.89 -0.03 0.00 -0.52 0.00 0.00 37.83 35.45 2a5m s LYS 154 CO 0.00 -0.36 0.06 -1.83 -0.92 0.00 0.00 175.35 172.30 2a5m s GLU 155 N -4.02 3.80 -0.37 1.68 -1.05 -1.26 -4.75 118.70 112.72 2a5m s GLU 155 Ca 0.29 -0.42 -0.14 0.00 -0.15 0.00 0.00 54.97 54.55 2a5m s GLU 155 Cb 0.01 -3.23 0.00 0.00 -0.44 0.00 0.00 34.13 30.47 2a5m s GLU 155 CO 0.17 0.06 0.26 0.71 0.95 0.00 0.00 175.26 177.41 2a5m s TYR 156 N 0.93 3.23 -0.06 4.83 1.51 -1.26 -4.94 117.35 121.59 2a5m s TYR 156 Ca 0.03 -0.43 0.14 0.00 -1.01 0.00 0.00 57.07 55.80 2a5m s TYR 156 Cb -0.14 -2.52 -0.17 0.00 -0.11 0.00 0.00 41.96 39.02 2a5m s TYR 156 CO 0.03 -0.48 0.84 0.00 -1.11 0.00 0.00 175.55 174.83 2a5m h ARG 157 N 8.55 0.00 -5.68 -0.62 2.47 -1.92 -3.38 114.38 113.79 2a5m h ARG 157 Ca -0.29 0.00 -0.47 0.00 -1.26 0.00 0.00 59.98 57.96 2a5m h ARG 157 Cb 1.14 0.00 -0.17 0.00 -1.65 0.00 0.00 29.97 29.29 2a5m h ARG 157 CO 0.68 0.47 -0.76 0.15 0.56 0.00 0.00 179.97 181.07 2a5m s LYS 158 N -2.76 1.20 0.41 0.04 1.02 -1.26 -3.52 119.74 114.87 2a5m s LYS 158 Ca -0.03 -1.39 0.07 0.00 0.02 0.00 0.00 55.97 54.65 2a5m s LYS 158 Cb 0.08 -1.14 0.86 0.00 -0.52 0.00 0.00 37.83 37.11 2a5m s LYS 158 CO 0.81 0.22 2.05 -1.00 -0.92 0.00 0.00 175.35 176.51 2a5m h PRO 159 N 3.20 0.55 0.00 -1.68 0.13 -1.89 -0.09 132.00 132.22 2a5m h PRO 159 Ca -0.41 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2a5m h PRO 159 Cb 1.20 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2a5m h PRO 159 CO 0.53 0.37 -0.02 0.28 -0.23 0.00 0.00 178.00 178.93 2a5m h VAL 160 N 0.57 0.13 0.00 1.56 2.07 -1.91 -1.91 116.25 116.76 2a5m h VAL 160 Ca 0.17 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2a5m h VAL 160 Cb 0.00 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2a5m h VAL 160 CO -0.04 0.02 -0.02 0.44 0.02 0.00 0.00 177.57 177.99 2a5m h ASP 161 N 0.00 0.00 -0.59 0.57 5.19 -1.30 -1.80 116.42 118.49 2a5m h ASP 161 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2a5m h ASP 161 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 2a5m h ASP 161 CO 0.00 0.02 0.00 -2.67 -3.12 0.00 0.00 179.24 173.47 2a5m n TRP 162 N -3.14 1.16 -0.56 4.55 2.14 -0.73 -4.93 117.44 115.93 2a5m n TRP 162 Ca -0.01 -0.59 0.00 0.00 2.07 0.00 0.00 57.50 58.97 2a5m n TRP 162 Cb 0.24 -0.16 0.00 0.00 -0.81 0.00 0.00 31.31 30.58 2a5m n TRP 162 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2a5m n GLY 163 N 1.01 0.71 3.83 -1.67 0.00 -0.68 -4.66 105.19 103.73 2a5m n GLY 163 Ca 0.23 -0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2a5m n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a5m s ALA 164 N -2.00 3.78 -1.28 4.61 0.00 -1.15 -4.97 121.76 120.75 2a5m s ALA 164 Ca 0.00 -0.67 0.27 0.00 0.00 0.00 0.00 51.96 51.57 2a5m s ALA 164 Cb 0.00 -1.95 0.94 0.00 0.00 0.00 0.00 23.12 22.11 2a5m s ALA 164 CO 0.00 0.53 1.70 0.00 0.00 0.00 0.00 175.76 177.99 2a5m n ALA 165 N 2.29 2.95 -2.96 0.00 0.00 -1.26 -3.27 120.51 118.25 2a5m n ALA 165 Ca -0.19 -0.27 -0.09 0.00 0.00 0.00 0.00 53.44 52.89 2a5m n ALA 165 Cb 0.54 -1.28 -0.11 0.00 0.00 0.00 0.00 19.45 18.61 2a5m n ALA 165 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2a5m s SER 166 N -2.79 0.25 0.00 0.00 1.04 -1.26 -4.99 113.70 105.96 2a5m s SER 166 Ca 0.19 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2a5m s SER 166 Cb 0.19 0.10 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2a5m s SER 166 CO 0.57 -0.30 0.60 -0.81 0.98 0.00 0.00 173.24 174.27 2a5m n PRO 167 N 1.57 0.73 -2.75 4.02 -0.04 -1.26 -4.79 135.00 132.47 2a5m n PRO 167 Ca -0.24 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.80 2a5m n PRO 167 Cb 0.55 -1.13 -0.03 0.00 -0.04 0.00 0.00 33.50 32.86 2a5m n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a5m s ALA 168 N -1.65 3.67 -0.16 0.55 0.00 -1.26 -1.95 121.76 120.95 2a5m s ALA 168 Ca 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 51.96 51.95 2a5m s ALA 168 Cb 0.00 -3.44 0.07 0.00 0.00 0.00 0.00 23.12 19.75 2a5m s ALA 168 CO 0.00 -0.99 0.36 0.42 0.00 0.00 0.00 175.76 175.56 2a5m s ILE 169 N 3.02 -0.32 -0.28 0.00 1.01 -1.26 -4.72 121.20 118.65 2a5m s ILE 169 Ca 0.41 0.16 0.08 0.00 0.00 0.00 0.00 60.65 61.30 2a5m s ILE 169 Cb -0.15 -0.57 -0.10 0.00 0.01 0.00 0.00 42.46 41.65 2a5m s ILE 169 CO 0.07 0.07 0.30 0.00 0.00 0.00 0.00 174.94 175.38 2a5m n GLN 170 N 4.87 3.10 -3.54 2.79 1.13 -0.63 -4.39 117.38 120.71 2a5m n GLN 170 Ca -0.15 -0.02 -0.12 0.00 -1.94 0.00 0.00 57.00 54.77 2a5m n GLN 170 Cb 0.52 -0.98 -0.04 0.00 0.11 0.00 0.00 30.24 29.85 2a5m n GLN 170 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2a5m s SER 171 N -2.13 -0.41 0.04 1.08 0.15 -1.01 -1.22 113.70 110.19 2a5m s SER 171 Ca 0.01 -0.09 -0.18 0.00 0.70 0.00 0.00 55.95 56.39 2a5m s SER 171 Cb 0.06 0.53 0.04 0.00 -1.71 0.00 0.00 66.02 64.93 2a5m s SER 171 CO 0.34 -0.88 0.41 0.72 1.20 0.00 0.00 173.24 175.04 2a5m s PHE 172 N -3.52 -0.27 0.00 3.44 -0.12 -0.90 0.09 117.98 116.71 2a5m s PHE 172 Ca 0.01 0.26 -0.05 0.00 -0.05 0.00 0.00 56.93 57.09 2a5m s PHE 172 Cb 0.00 0.21 -0.00 0.00 -0.63 0.00 0.00 43.02 42.60 2a5m s PHE 172 CO -0.10 -0.56 0.10 1.03 -0.05 0.00 0.00 175.22 175.64 2a5m s ARG 173 N -2.33 0.42 0.18 1.99 0.52 -0.10 -1.91 118.95 117.73 2a5m s ARG 173 Ca -0.06 -0.41 -0.20 0.00 -0.52 0.00 0.00 55.73 54.53 2a5m s ARG 173 Cb -0.01 0.17 -0.08 0.00 0.52 0.00 0.00 34.95 35.55 2a5m s ARG 173 CO -0.01 -0.09 0.69 -0.98 0.02 0.00 0.00 175.30 174.93 2a5m s ARG 174 N -1.31 4.28 -0.16 3.54 1.70 -1.26 -1.02 118.95 124.72 2a5m s ARG 174 Ca -0.14 0.87 -0.16 0.00 -0.47 0.00 0.00 55.73 55.83 2a5m s ARG 174 Cb -0.08 -3.03 -0.04 0.00 -0.57 0.00 0.00 34.95 31.23 2a5m s ARG 174 CO 0.01 0.48 0.38 0.42 -1.08 0.00 0.00 175.30 175.51 2a5m s ILE 175 N -1.37 5.24 0.03 4.99 1.01 -0.95 -4.92 121.20 125.23 2a5m s ILE 175 Ca 0.39 0.71 0.02 0.00 0.00 0.00 0.00 60.65 61.76 2a5m s ILE 175 Cb -0.18 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 2a5m s ILE 175 CO 0.22 0.33 -0.06 -0.69 0.00 0.00 0.00 174.94 174.73 2a5m s VAL 176 N 0.79 0.44 -1.69 2.92 1.01 -1.26 -4.71 120.40 117.90 2a5m s VAL 176 Ca 0.20 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.35 2a5m s VAL 176 Cb -0.14 -0.49 0.00 0.00 0.00 0.00 0.00 36.38 35.75 2a5m s VAL 176 CO 0.07 -0.27 0.42 1.21 0.00 0.00 0.00 175.10 176.53